tetrakis(4-methylpent-2-en-2-ylamino) silicate

C24H48N4O4Si — CID 54175568

IUPACtetrakis(4-methylpent-2-en-2-ylamino) silicate
SMILESCC(=CC(C)C)NO[Si](ONC(C)=CC(C)C)(ONC(C)=CC(C)C)ONC(C)=CC(C)C
InChIInChI=1S/C24H48N4O4Si/c1-17(2)13-21(9)25-29-33(30-26-22(10)14-18(3)4,31-27-23(11)15-19(5)6)32-28-24(12)16-20(7)8/h13-20,25-28H,1-12H3
InChIKeyOYCDXNVIWUHHNL-UHFFFAOYSA-N
MW484.76 g/mol
LogP5.75
Rot. Bonds16

About tetrakis(4-methylpent-2-en-2-ylamino) silicate

tetrakis(4-methylpent-2-en-2-ylamino) silicate (PubChem CID 54175568) has the molecular formula C24H48N4O4Si and a molecular weight of 484.76 g/mol. Its IUPAC name is tetrakis(4-methylpent-2-en-2-ylamino) silicate.

Molecular Properties

Compound Nametetrakis(4-methylpent-2-en-2-ylamino) silicate
PubChem CID54175568
Molecular FormulaC24H48N4O4Si
Molecular Weight484.76 g/mol
Exact Mass484.34
IUPAC Nametetrakis(4-methylpent-2-en-2-ylamino) silicate
SMILESCC(=CC(C)C)NO[Si](ONC(C)=CC(C)C)(ONC(C)=CC(C)C)ONC(C)=CC(C)C
InChIInChI=1S/C24H48N4O4Si/c1-17(2)13-21(9)25-29-33(30-26-22(10)14-18(3)4,31-27-23(11)15-19(5)6)32-28-24(12)16-20(7)8/h13-20,25-28H,1-12H3
InChIKeyOYCDXNVIWUHHNL-UHFFFAOYSA-N
XLogP5.75
TPSA85.04 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.76
LogP ≤ 55.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetrakis(4-methylpent-2-en-2-ylamino) silicate?
The IUPAC name of tetrakis(4-methylpent-2-en-2-ylamino) silicate (CID 54175568) is tetrakis(4-methylpent-2-en-2-ylamino) silicate.
What is the SMILES notation for tetrakis(4-methylpent-2-en-2-ylamino) silicate?
The canonical SMILES for tetrakis(4-methylpent-2-en-2-ylamino) silicate is CC(=CC(C)C)NO[Si](ONC(C)=CC(C)C)(ONC(C)=CC(C)C)ONC(C)=CC(C)C.
What is the InChIKey of tetrakis(4-methylpent-2-en-2-ylamino) silicate?
The InChIKey is OYCDXNVIWUHHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48N4O4Si/c1-17(2)13-21(9)25-29-33(30-26-22(10)14-18(3)4,31-27-23(11)15-19(5)6)32-28-24(12)16-20(7)8/h13-20,25-28H,1-12H3.
What are the key properties of tetrakis(4-methylpent-2-en-2-ylamino) silicate?
tetrakis(4-methylpent-2-en-2-ylamino) silicate has a molecular weight of 484.76 g/mol, XLogP of 5.75, 16 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(4-methylpent-2-en-2-ylamino) silicate is sourced from PubChem (CID 54175568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).